F9O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL1 | C13 | sing | 1.74Å | 1.75Å | |
| C12 | C13 | doub | 1.39Å | 1.38Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | CL | sing | 1.74Å | 1.72Å | |
| C14 | C9 | doub | 1.40Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.40Å | 1.40Å | Aromatic |
| C10 | N1 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | N2 | sing | 1.36Å | 1.38Å | Aromatic |
| N | C3 | sing | 1.47Å | 1.47Å | |
| N | C4 | sing | 1.47Å | 1.47Å | |
| N1 | C7 | sing | 1.46Å | 1.47Å | |
| N1 | C8 | sing | 1.36Å | 1.37Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.51Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| N2 | C8 | doub | 1.30Å | 1.31Å | Aromatic |
| C4 | C | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C | C1 | sing | 1.53Å | 1.51Å | |
| C | O | sing | 1.43Å | 1.42Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| N | H12 | sing | 1.01Å | 1.00Å | |
| C | H14 | sing | 1.09Å | 1.10Å | |
| O | H15 | sing | 0.97Å | 0.95Å | |
| C11 | H16 | sing | 1.08Å | 1.08Å | |
| C12 | H17 | sing | 1.08Å | 1.08Å | |
| C7 | H18 | sing | 1.09Å | 1.10Å | |
| C7 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C13 | C12 | 118.3° | 119.8° |
| CL1 | C13 | C14 | 119.9° | 119.7° |
| C13 | C12 | C11 | 119.4° | 120.4° |
| C12 | C13 | C14 | 121.8° | 120.5° |
| C13 | C12 | H17 | 120.3° | 119.7° |
| C12 | C11 | C10 | 118.6° | 119.9° |
| C12 | C11 | H16 | 120.7° | 120.0° |
| C11 | C12 | H17 | 120.3° | 119.9° |
| C13 | C14 | CL | 121.0° | 120.2° |
| C13 | C14 | C9 | 120.2° | 119.7° |
| C11 | C10 | C9 | 123.1° | 120.0° |
| C11 | C10 | N1 | 131.4° | 134.0° |
| C10 | C11 | H16 | 120.7° | 120.1° |
| CL | C14 | C9 | 118.7° | 120.1° |
| C14 | C9 | C10 | 116.9° | 119.4° |
| C14 | C9 | N2 | 132.6° | 133.6° |
| C9 | C10 | N1 | 105.5° | 106.0° |
| C10 | C9 | N2 | 110.4° | 107.0° |
| C10 | N1 | C7 | 126.6° | 126.4° |
| C10 | N1 | C8 | 106.2° | 107.3° |
| C9 | N2 | C8 | 104.2° | 109.6° |
| C3 | N | C4 | 115.8° | 111.2° |
| N | C3 | C2 | 112.1° | 109.5° |
| N | C3 | H6 | 108.8° | 109.4° |
| N | C3 | H7 | 108.8° | 109.4° |
| C3 | N | H12 | 107.8° | 111.0° |
| N | C4 | C5 | 99.5° | 109.4° |
| N | C4 | C | 107.6° | 109.6° |
| N | C4 | H1 | 110.6° | 109.5° |
| C4 | N | H12 | 107.9° | 111.0° |
| C7 | N1 | C8 | 127.2° | 126.3° |
| N1 | C7 | C6 | 113.6° | 109.5° |
| N1 | C7 | H18 | 108.4° | 109.4° |
| N1 | C7 | H19 | 108.4° | 109.5° |
| N1 | C8 | N2 | 113.7° | 110.1° |
| N1 | C8 | H20 | 123.2° | 125.0° |
| C3 | C2 | C1 | 110.4° | 109.3° |
| C2 | C3 | H6 | 108.8° | 109.5° |
| C2 | C3 | H7 | 108.8° | 109.5° |
| C3 | C2 | H8 | 109.2° | 109.5° |
| C3 | C2 | H9 | 109.2° | 109.4° |
| C7 | C6 | C5 | 108.1° | 109.5° |
| C7 | C6 | H4 | 109.8° | 109.5° |
| C7 | C6 | H5 | 109.8° | 109.5° |
| C6 | C7 | H18 | 108.4° | 109.5° |
| C6 | C7 | H19 | 108.4° | 109.5° |
| C4 | C5 | C6 | 117.2° | 109.4° |
| C5 | C4 | C | 118.7° | 109.4° |
| C5 | C4 | H1 | 109.9° | 109.5° |
| C4 | C5 | H2 | 107.5° | 109.5° |
| C4 | C5 | H3 | 107.5° | 109.5° |
| C6 | C5 | H2 | 107.5° | 109.4° |
| C6 | C5 | H3 | 107.5° | 109.5° |
| C5 | C6 | H4 | 109.8° | 109.5° |
| C5 | C6 | H5 | 109.8° | 109.5° |
| N2 | C8 | H20 | 123.1° | 124.9° |
| C4 | C | C1 | 110.9° | 109.3° |
| C4 | C | O | 113.8° | 109.5° |
| C | C4 | H1 | 109.9° | 109.5° |
| C4 | C | H14 | 107.2° | 109.6° |
| C2 | C1 | C | 106.5° | 109.2° |
| C1 | C2 | H8 | 109.2° | 109.5° |
| C1 | C2 | H9 | 109.2° | 109.5° |
| C2 | C1 | H10 | 110.2° | 109.5° |
| C2 | C1 | H11 | 110.2° | 109.5° |
| C1 | C | O | 108.8° | 109.5° |
| C | C1 | H10 | 110.2° | 109.5° |
| C | C1 | H11 | 110.2° | 109.6° |
| C1 | C | H14 | 107.3° | 109.4° |
| O | C | H14 | 108.5° | 109.5° |
| C | O | H15 | 109.5° | 114.0° |
| H2 | C5 | H3 | 109.5° | 109.5° |
| H4 | C6 | H5 | 109.5° | 109.4° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H8 | C2 | H9 | 109.5° | 109.6° |
| H10 | C1 | H11 | 109.4° | 109.5° |
| H18 | C7 | H19 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C13 | C12 | C14 | 179.3° | 180.0° |
| CL1 | C13 | C12 | C11 | 179.4° | 180.0° |
| CL1 | C13 | C14 | CL | 0.1° | 0.0° |
| CL1 | C13 | C14 | C9 | 179.2° | 180.0° |
| CL1 | C13 | C12 | H17 | 0.6° | 0.0° |
| C13 | C12 | C11 | H17 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 0.1° | 0.0° |
| C12 | C13 | C14 | CL | 179.4° | 180.0° |
| C12 | C13 | C14 | C9 | 0.0° | 0.0° |
| C13 | C12 | C11 | H16 | 179.9° | 180.0° |
| C11 | C12 | C13 | C14 | 0.1° | 0.0° |
| C12 | C11 | C10 | H16 | 180.0° | 180.0° |
| C12 | C11 | C10 | C9 | 0.5° | 0.0° |
| C12 | C11 | C10 | N1 | 177.9° | 179.6° |
| C13 | C14 | CL | C9 | 179.3° | 180.0° |
| C13 | C14 | C9 | C10 | 0.4° | 0.0° |
| C13 | C14 | C9 | N2 | 177.3° | 179.6° |
| C14 | C13 | C12 | H17 | 179.8° | 180.0° |
| C11 | C10 | C9 | C14 | 0.7° | 0.0° |
| C11 | C10 | C9 | N1 | 178.0° | 179.7° |
| C11 | C10 | C9 | N2 | 177.6° | 179.7° |
| C11 | C10 | N1 | C7 | 0.1° | 0.4° |
| C11 | C10 | N1 | C8 | 177.4° | 179.7° |
| C10 | C11 | C12 | H17 | 179.9° | 180.0° |
| CL | C14 | C9 | C10 | 179.7° | 180.0° |
| CL | C14 | C9 | N2 | 2.0° | 0.3° |
| C14 | C9 | C10 | N2 | 178.2° | 179.7° |
| C14 | C9 | C10 | N1 | 178.6° | 179.7° |
| C14 | C9 | N2 | C8 | 178.2° | 179.7° |
| C9 | C10 | N1 | C7 | 177.8° | 180.0° |
| C9 | C10 | N1 | C8 | 0.3° | 0.0° |
| C10 | C9 | N2 | C8 | 0.3° | 0.0° |
| C9 | C10 | C11 | H16 | 179.4° | 180.0° |
| N1 | C10 | C9 | N2 | 0.4° | 0.0° |
| C10 | N1 | C7 | C8 | 177.0° | 179.9° |
| C10 | N1 | C7 | C6 | 133.4° | 85.0° |
| C10 | N1 | C8 | N2 | 0.1° | 0.1° |
| N1 | C10 | C11 | H16 | 2.0° | 0.4° |
| C10 | N1 | C7 | H18 | 106.0° | 35.0° |
| C10 | N1 | C7 | H19 | 12.7° | 154.9° |
| C10 | N1 | C8 | H20 | 179.9° | 180.0° |
| C9 | N2 | C8 | N1 | 0.1° | 0.1° |
| C9 | N2 | C8 | H20 | 179.9° | 180.0° |
| C3 | N | C4 | H12 | 120.9° | 124.1° |
| N | C3 | C2 | H6 | 120.4° | 120.0° |
| N | C3 | C2 | H7 | 120.4° | 120.0° |
| C3 | N | C4 | C5 | 177.5° | 178.3° |
| C3 | N | C4 | C | 53.1° | 61.8° |
| N | C3 | C2 | C1 | 52.7° | 59.1° |
| C3 | N | C4 | H1 | 67.0° | 58.3° |
| N | C3 | H6 | H7 | 118.8° | 119.9° |
| N | C3 | C2 | H8 | 172.8° | 179.1° |
| N | C3 | C2 | H9 | 67.5° | 60.8° |
| C4 | N | C3 | C2 | 50.8° | 61.7° |
| N | C4 | C5 | C | 116.2° | 120.0° |
| N | C4 | C5 | H1 | 116.2° | 120.0° |
| N | C4 | C5 | C6 | 175.6° | 65.0° |
| N | C4 | C | H1 | 120.6° | 120.0° |
| N | C4 | C | C1 | 60.4° | 59.2° |
| N | C4 | C | O | 176.5° | 179.1° |
| N | C4 | C5 | H2 | 54.5° | 175.1° |
| N | C4 | C5 | H3 | 63.3° | 55.1° |
| C4 | N | C3 | H6 | 69.6° | 178.3° |
| C4 | N | C3 | H7 | 171.2° | 58.3° |
| N | C4 | C | H14 | 56.5° | 60.7° |
| N1 | C7 | C6 | H18 | 120.6° | 120.0° |
| N1 | C7 | C6 | H19 | 120.6° | 120.1° |
| N1 | C7 | C6 | C5 | 96.3° | 180.0° |
| C7 | N1 | C8 | N2 | 177.6° | 180.0° |
| N1 | C7 | C6 | H4 | 23.5° | 60.0° |
| N1 | C7 | C6 | H5 | 143.9° | 59.9° |
| N1 | C7 | H18 | H19 | 118.1° | 120.0° |
| C7 | N1 | C8 | H20 | 2.4° | 0.0° |
| C8 | N1 | C7 | C6 | 49.7° | 95.0° |
| N1 | C8 | N2 | H20 | 180.0° | 180.0° |
| C8 | N1 | C7 | H18 | 71.0° | 145.0° |
| C8 | N1 | C7 | H19 | 170.3° | 25.0° |
| C3 | C2 | C1 | H8 | 120.1° | 120.0° |
| C3 | C2 | C1 | H9 | 120.1° | 119.9° |
| C3 | C2 | C1 | C | 59.1° | 57.6° |
| C2 | C3 | H6 | H7 | 118.8° | 120.0° |
| C3 | C2 | H8 | H9 | 119.6° | 120.0° |
| C3 | C2 | C1 | H10 | 60.5° | 62.2° |
| C3 | C2 | C1 | H11 | 178.6° | 177.6° |
| C2 | C3 | N | H12 | 70.1° | 62.4° |
| C7 | C6 | C5 | C4 | 160.6° | 180.0° |
| C7 | C6 | C5 | H4 | 119.8° | 120.0° |
| C7 | C6 | C5 | H5 | 119.8° | 120.0° |
| C7 | C6 | C5 | H2 | 78.3° | 60.1° |
| C7 | C6 | C5 | H3 | 39.5° | 60.0° |
| C7 | C6 | H4 | H5 | 120.6° | 120.0° |
| C6 | C7 | H18 | H19 | 118.1° | 120.0° |
| C4 | C5 | C6 | H2 | 121.1° | 119.9° |
| C4 | C5 | C6 | H3 | 121.1° | 120.0° |
| C5 | C4 | C | H1 | 127.6° | 120.0° |
| C5 | C4 | C | C1 | 172.3° | 179.2° |
| C5 | C4 | C | O | 64.7° | 60.9° |
| C4 | C5 | H2 | H3 | 116.5° | 120.0° |
| C4 | C5 | C6 | H4 | 79.6° | 60.0° |
| C4 | C5 | C6 | H5 | 40.8° | 60.0° |
| C5 | C4 | N | H12 | 56.6° | 57.6° |
| C5 | C4 | C | H14 | 55.3° | 59.3° |
| C6 | C5 | C4 | C | 59.4° | 175.0° |
| C6 | C5 | C4 | H1 | 68.2° | 55.0° |
| C6 | C5 | H2 | H3 | 116.5° | 120.1° |
| C5 | C6 | H4 | H5 | 120.7° | 120.0° |
| C5 | C6 | C7 | H18 | 143.1° | 60.0° |
| C5 | C6 | C7 | H19 | 24.3° | 60.0° |
| C4 | C | C1 | C2 | 64.4° | 57.6° |
| C4 | C | C1 | O | 125.9° | 119.9° |
| C4 | C | C1 | H14 | 116.9° | 120.0° |
| C4 | C | O | H14 | 119.3° | 120.2° |
| C | C4 | C5 | H2 | 61.7° | 55.0° |
| C | C4 | C5 | H3 | 179.5° | 65.0° |
| C4 | C | C1 | H10 | 55.2° | 62.2° |
| C4 | C | C1 | H11 | 176.1° | 177.6° |
| C | C4 | N | H12 | 67.7° | 62.3° |
| C4 | C | O | H15 | 180.0° | 180.0° |
| C2 | C1 | C | H10 | 119.6° | 119.9° |
| C2 | C1 | C | H11 | 119.5° | 120.0° |
| C2 | C1 | C | O | 169.7° | 177.6° |
| C1 | C2 | C3 | H6 | 67.7° | 179.1° |
| C1 | C2 | C3 | H7 | 173.1° | 60.8° |
| C1 | C2 | H8 | H9 | 119.6° | 120.1° |
| C2 | C1 | H10 | H11 | 121.4° | 120.1° |
| C2 | C1 | C | H14 | 52.5° | 62.3° |
| C1 | C | O | H14 | 116.5° | 120.0° |
| C1 | C | C4 | H1 | 60.1° | 60.8° |
| C | C1 | C2 | H8 | 179.2° | 177.6° |
| C | C1 | C2 | H9 | 61.1° | 62.3° |
| C | C1 | H10 | H11 | 121.4° | 120.2° |
| C1 | C | O | H15 | 55.8° | 60.2° |
| O | C | C4 | H1 | 62.9° | 59.1° |
| O | C | C1 | H10 | 70.7° | 57.7° |
| O | C | C1 | H11 | 50.2° | 62.4° |
| H1 | C4 | C5 | H2 | 170.7° | 64.9° |
| H1 | C4 | C5 | H3 | 52.9° | 175.0° |
| H1 | C4 | N | H12 | 172.1° | 177.6° |
| H1 | C4 | C | H14 | 177.0° | 179.3° |
| H2 | C5 | C6 | H4 | 41.5° | 180.0° |
| H2 | C5 | C6 | H5 | 162.0° | 60.0° |
| H3 | C5 | C6 | H4 | 159.3° | 60.0° |
| H3 | C5 | C6 | H5 | 80.3° | 180.0° |
| H4 | C6 | C7 | H18 | 97.1° | 180.0° |
| H4 | C6 | C7 | H19 | 144.1° | 60.0° |
| H5 | C6 | C7 | H18 | 23.3° | 60.0° |
| H5 | C6 | C7 | H19 | 95.5° | 180.0° |
| H6 | C3 | C2 | H8 | 52.4° | 60.9° |
| H6 | C3 | C2 | H9 | 172.1° | 59.2° |
| H6 | C3 | N | H12 | 169.5° | 57.6° |
| H7 | C3 | C2 | H8 | 66.8° | 59.1° |
| H7 | C3 | C2 | H9 | 52.9° | 179.2° |
| H7 | C3 | N | H12 | 50.3° | 177.6° |
| H8 | C2 | C1 | H10 | 59.6° | 57.7° |
| H8 | C2 | C1 | H11 | 61.3° | 62.4° |
| H9 | C2 | C1 | H10 | 179.4° | 177.9° |
| H9 | C2 | C1 | H11 | 58.5° | 57.8° |
| H10 | C1 | C | H14 | 172.0° | 177.8° |
| H11 | C1 | C | H14 | 67.0° | 57.6° |
| H14 | C | O | H15 | 60.7° | 59.9° |
| H16 | C11 | C12 | H17 | 0.1° | 0.0° |
